N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-ethylsulfanyl-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-ethylsulfanyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethylsulfanyl-N-(2-pyridylmethyl)benzamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(ethylthio)-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethylsulfanyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(ethylthio)-N-(2-pyridylmethyl)benzamide Formula: C22H18ClN3OS2 MolecularWeight: 439.98082

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN3OS2/c1-2-28-19-9-4-3-8-17(19)21(27)26(14-16-7-5-6-12-24-16)22-25-18-11-10-15(23)13-20(18)29-22/h3-13H,2,14H2,1H3